ethyl N-(propan-2-ylideneamino)carbamate
TL;DR: ethyl N-(propan-2-ylideneamino)carbamate (CAS 7626-72-4) is a chemical compound with molecular formula C6H12N2O2 and molecular weight 144.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(propan-2-ylideneamino)carbamate
Also Known As: ethyl N-(propan-2-ylideneamino)carbamate, ethyl 3-isopropylidenecarbazate, 3-Isopropylidenecarbazic acid ethyl ester, ethyl 2-(propan-2-ylidene)hydrazinecarboxylate, Ethyl 2-(propan-2-ylidene)hydrazine-1-carboxylate
| Molecular Formula | C6H12N2O2 |
|---|---|
| Molecular Weight | 144.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 144.08987 |
| Heavy Atoms | 10 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 7626-72-4 |
|---|---|
| SMILES | CCOC(=O)NN=C(C)C |
| InChIKey | PYWYEFXRQPIDET-UHFFFAOYSA-N |
Product Overview
ethyl N-(propan-2-ylideneamino)carbamate (CAS 7626-72-4), with molecular formula C6H12N2O2 and molecular weight 144.09 g/mol. IUPAC: ethyl N-(propan-2-ylideneamino)carbamate.
Chemical Property Profile of ethyl N-(propan-2-ylideneamino)carbamate
Property Insights of ethyl N-(propan-2-ylideneamino)carbamate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-(propan-2-ylideneamino)carbamate. With a topological polar surface area (TPSA) of 50.7 Ų, ethyl N-(propan-2-ylideneamino)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-(propan-2-ylideneamino)carbamate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl N-(propan-2-ylideneamino)carbamate?
The CAS number of ethyl N-(propan-2-ylideneamino)carbamate is 7626-72-4.
What is the molecular formula of ethyl N-(propan-2-ylideneamino)carbamate?
The molecular formula of ethyl N-(propan-2-ylideneamino)carbamate is C6H12N2O2.
What is the molecular weight of ethyl N-(propan-2-ylideneamino)carbamate?
The molecular weight of ethyl N-(propan-2-ylideneamino)carbamate is 144.09 g/mol.
Where can I buy ethyl N-(propan-2-ylideneamino)carbamate?
You can request a quote for ethyl N-(propan-2-ylideneamino)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-(propan-2-ylideneamino)carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-(propan-2-ylideneamino)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.